⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14567564 | 0.70 | — | — | |
| SCHEMBL8399551 | 0.67 | — | — | |
| SCHEMBL1121683 | 0.64 | — | — | |
| SCHEMBL10589577 | 0.60 | — | — | |
| Methyl Alcohol SCHEMBL17200864 | 0.56 | — | — | |
| SCHEMBL15139340 | 0.55 | — | — | |
| SCHEMBL18083625 | 0.55 | — | — | |
| SCHEMBL2812909 | 0.55 | — | — | |
| SCHEMBL9483267 | 0.55 | — | — | |
| SCHEMBL18216687 | 0.55 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0043507-A2 | 2,4-Dioxa-7,10 methano-spiro(5,5)undecanes, their preparation as well as perfume compositions containing them | Henkel Kommanditgesellschaft auf Aktien (DE) | 1982-01-13 | — | — | EP | claimed |
| US-4528126-A | 2,4-Dioxa-7,10-methano-spiro [5,5] undecanes and their use in perfumery compositions | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1985-07-09 | — | — | US | disclosed |
| EP-0043507-B1 | 2,4-DIOXA-7,10 METHANO-SPIRO(5,5)UNDECANES, THEIR PREPARATION AS WELL AS PERFUME COMPOSITIONS CONTAINING THEM | Henkel Kommanditgesellschaft auf Aktien (DE) | 1984-08-22 | — | — | EP | disclosed |
| EP-0043507-A2 | 2,4-Dioxa-7,10 methano-spiro(5,5)undecanes, their preparation as well as perfume compositions containing them | Henkel Kommanditgesellschaft auf Aktien (DE) | 1982-01-13 | — | — | EP | disclosed |